cyclohexen-1-yl 5-[2,4-bis(trifluoromethyl)phenoxy]-2-nitro-benzoate

Systemtic Name: cyclohexen-1-yl 5-[2,4-bis(trifluoromethyl)phenoxy]-2-nitro-benzoate Openeye Name: cyclohexen-1-yl 5-[2,4-bis(trifluoromethyl)phenoxy]-2-nitro-benzoate CAS Name: 5-[2,4-bis(trifluoromethyl)phenoxy]-2-nitrobenzoic acid 1-cyclohexenyl ester IUPAC Name: cyclohexen-1-yl 5-[2,4-bis(trifluoromethyl)phenoxy]-2-nitrobenzoate Traditional Name: 5-[2,4-bis(trifluoromethyl)phenoxy]-2-nitro-benzoic acid cyclohexen-1-yl ester Formula: C21H15F6NO5 MolecularWeight: 475.337919

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)OC(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCC(=CC1)OC(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H15F6NO5/c22-20(23,24)12-6-9-18(16(10-12)21(25,26)27)32-14-7-8-17(28(30)31)15(11-14)19(29)33-13-4-2-1-3-5-13/h4,6-11H,1-3,5H2